1,2,3,4-tetrahydronaphthalene

C10H12 — CID 8404

IUPAC1,2,3,4-tetrahydronaphthalene
SMILESc1ccc2c(c1)CCCC2
InChIInChI=1S/C10H12/c1-2-6-10-8-4-3-7-9(10)5-1/h1-2,5-6H,3-4,7-8H2
InChIKeyCXWXQJXEFPUFDZ-UHFFFAOYSA-N
MW132.21 g/mol
LogP2.57
Rot. Bonds

About 1,2,3,4-tetrahydronaphthalene

1,2,3,4-tetrahydronaphthalene (PubChem CID 8404) has the molecular formula C10H12 and a molecular weight of 132.21 g/mol. Its IUPAC name is 1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1,2,3,4-tetrahydronaphthalene
PubChem CID8404
Molecular FormulaC10H12
Molecular Weight132.21 g/mol
Exact Mass132.09
IUPAC Name1,2,3,4-tetrahydronaphthalene
SMILESc1ccc2c(c1)CCCC2
InChIInChI=1S/C10H12/c1-2-6-10-8-4-3-7-9(10)5-1/h1-2,5-6H,3-4,7-8H2
InChIKeyCXWXQJXEFPUFDZ-UHFFFAOYSA-N
XLogP2.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.21
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1,2,3,4-tetrahydronaphthalene (CID 8404) is 1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1,2,3,4-tetrahydronaphthalene is c1ccc2c(c1)CCCC2.
What is the InChIKey of 1,2,3,4-tetrahydronaphthalene?
The InChIKey is CXWXQJXEFPUFDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12/c1-2-6-10-8-4-3-7-9(10)5-1/h1-2,5-6H,3-4,7-8H2.
What are the key properties of 1,2,3,4-tetrahydronaphthalene?
1,2,3,4-tetrahydronaphthalene has a molecular weight of 132.21 g/mol, XLogP of 2.57, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 8404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).